==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/DNA 02-JAN-03 1NJW . COMPND 2 MOLECULE: DNA PRIMER STRAND; . SOURCE 2 SYNTHETIC: YES; . AUTHOR S.J.JOHNSON,L.S.BEESE . 580 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 27605.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 416 71.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 13 2.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 51 8.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 29 5.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 56 9.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 239 41.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 21 3.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 3 1 2 1 4 3 1 0 0 1 2 1 0 1 1 0 0 0 0 0 0 0 1 0 1 0 1 RESIDUES PER ALPHA HELIX . 0 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 2 2 2 1 2 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 2 0 2 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 297 A A 0 0 142 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -23.6 9.0 5.5 2.2 2 298 A K - 0 0 80 1,-0.1 2,-0.4 0, 0.0 147,-0.0 0.059 360.0-116.4 -41.1 147.3 10.6 8.4 0.4 3 299 A M - 0 0 30 1,-0.0 2,-0.1 146,-0.0 -1,-0.1 -0.790 26.7-123.3 -94.9 133.5 8.3 11.4 -0.1 4 300 A A + 0 0 71 -2,-0.4 2,-0.3 148,-0.0 -1,-0.0 -0.434 45.3 140.6 -75.3 147.1 7.5 12.4 -3.6 5 301 A F - 0 0 59 -2,-0.1 2,-0.5 41,-0.1 43,-0.2 -0.940 49.5 -99.1-176.9 159.8 8.3 15.9 -4.9 6 302 A T E -a 48 0A 76 41,-2.7 43,-2.6 -2,-0.3 2,-1.5 -0.818 18.6-150.3 -96.4 123.9 9.6 17.9 -7.9 7 303 A L E -a 49 0A 71 -2,-0.5 43,-0.1 41,-0.2 2,-0.1 -0.730 32.8-154.2 -89.9 85.2 13.2 18.9 -7.9 8 304 A A E -a 50 0A 7 -2,-1.5 43,-0.5 41,-1.4 3,-0.1 -0.364 29.0-169.4 -69.9 139.7 12.5 22.0 -10.0 9 305 A D S S+ 0 0 123 1,-0.2 2,-0.3 -2,-0.1 -1,-0.1 0.525 81.4 20.6 -99.1 -12.4 15.1 23.7 -12.2 10 306 A R S S- 0 0 164 48,-0.0 2,-0.3 44,-0.0 -1,-0.2 -0.984 87.7 -98.0-152.8 157.3 12.8 26.7 -12.8 11 307 A V - 0 0 8 -2,-0.3 2,-0.3 43,-0.1 49,-0.1 -0.588 38.8-169.3 -80.9 137.3 9.8 28.3 -11.1 12 308 A T > - 0 0 36 -2,-0.3 3,-1.6 1,-0.1 4,-0.2 -0.839 34.2-106.9-124.1 163.2 6.3 27.6 -12.5 13 309 A E G > S+ 0 0 139 -2,-0.3 3,-2.2 1,-0.3 -1,-0.1 0.842 114.7 59.7 -57.3 -40.2 2.8 29.0 -11.9 14 310 A E G > S+ 0 0 93 1,-0.3 3,-0.6 2,-0.1 31,-0.3 0.638 96.9 64.2 -66.8 -10.2 1.5 26.2 -9.9 15 311 A M G < S+ 0 0 3 -3,-1.6 -1,-0.3 1,-0.2 -2,-0.2 0.529 96.5 60.3 -85.8 -7.1 4.3 26.9 -7.4 16 312 A L G < S+ 0 0 19 -3,-2.2 -1,-0.2 -4,-0.2 -2,-0.1 -0.111 71.3 149.9-113.8 36.5 2.7 30.3 -6.8 17 313 A A < - 0 0 12 -3,-0.6 -3,-0.0 2,-0.1 3,-0.0 -0.176 60.0-108.9 -62.7 161.8 -0.7 29.2 -5.5 18 314 A D S S+ 0 0 103 1,-0.1 53,-2.4 52,-0.1 2,-0.3 0.385 103.5 41.5 -78.9 4.4 -2.4 31.6 -3.0 19 315 A K E S+b 71 0A 72 51,-0.2 25,-0.5 2,-0.1 2,-0.3 -0.940 72.5 142.8-149.3 129.8 -1.9 29.2 -0.1 20 316 A A E -b 72 0A 0 51,-2.0 53,-2.5 -2,-0.3 2,-0.5 -0.994 49.7-115.7-164.0 155.6 1.2 27.2 0.7 21 317 A A E -bC 73 42A 0 21,-3.0 21,-2.4 -2,-0.3 2,-0.4 -0.859 44.2-162.9 -92.1 129.4 3.6 25.8 3.3 22 318 A L E - C 0 41A 1 51,-2.6 2,-0.4 -2,-0.5 53,-0.4 -0.955 17.4-169.2-123.4 138.3 6.9 27.5 2.6 23 319 A V E + C 0 40A 9 17,-2.5 17,-2.3 -2,-0.4 2,-0.5 -0.993 8.5 175.3-127.0 121.4 10.4 26.6 3.8 24 320 A V E - C 0 39A 10 -2,-0.4 2,-0.4 15,-0.2 15,-0.2 -0.889 31.0-146.0-125.1 89.4 13.3 29.1 3.2 25 321 A E E + C 0 38A 17 13,-1.9 12,-2.0 -2,-0.5 13,-0.6 -0.478 27.0 174.2 -73.4 120.8 16.1 27.3 5.0 26 322 A V - 0 0 6 -2,-0.4 10,-0.1 10,-0.2 5,-0.1 -0.967 4.5-178.2-123.5 107.7 18.8 29.2 6.9 27 323 A V + 0 0 14 -2,-0.5 -1,-0.1 8,-0.4 9,-0.1 0.868 53.0 93.8 -77.8 -40.0 21.0 26.7 8.7 28 324 A E S S- 0 0 119 7,-0.3 6,-0.1 1,-0.1 -2,-0.0 -0.311 77.8-132.2 -54.3 134.0 23.4 29.0 10.4 29 325 A E S S+ 0 0 142 1,-0.2 2,-0.9 2,-0.1 -1,-0.1 0.917 101.0 56.2 -55.9 -46.4 22.1 29.7 14.0 30 326 A N S S- 0 0 31 1,-0.1 -1,-0.2 2,-0.1 -2,-0.1 -0.804 74.7-170.0 -89.7 108.5 22.6 33.4 13.5 31 327 A Y > + 0 0 2 -2,-0.9 3,-1.9 3,-0.1 2,-0.2 0.493 40.2 124.3 -81.1 -3.4 20.6 34.2 10.4 32 328 A H T 3 S- 0 0 6 1,-0.3 51,-0.1 275,-0.2 -2,-0.1 -0.422 96.7 -15.1 -63.6 122.3 21.8 37.8 9.8 33 329 A D T 3 S+ 0 0 94 49,-0.3 -1,-0.3 -2,-0.2 50,-0.1 0.783 107.5 150.6 53.5 30.4 23.2 38.1 6.3 34 330 A A < - 0 0 9 -3,-1.9 -1,-0.2 1,-0.1 -3,-0.1 -0.502 50.2 -93.0 -91.8 159.2 23.3 34.3 6.3 35 331 A P - 0 0 78 0, 0.0 2,-0.7 0, 0.0 -8,-0.4 -0.379 21.8-140.2 -72.6 147.2 23.0 31.9 3.4 36 332 A I - 0 0 11 -10,-0.1 -10,-0.2 1,-0.1 17,-0.1 -0.946 19.2-171.5-103.5 112.3 19.6 30.4 2.3 37 333 A V - 0 0 34 -12,-2.0 2,-0.3 -2,-0.7 -11,-0.1 0.623 57.5 -16.1 -83.1 -14.8 20.5 26.8 1.4 38 334 A G E -C 25 0A 0 -13,-0.6 -13,-1.9 13,-0.1 2,-0.4 -0.955 53.0-134.7 179.8 161.8 17.3 25.7 -0.2 39 335 A I E -CD 24 50A 1 11,-1.9 11,-2.8 -2,-0.3 2,-0.4 -0.980 14.4-172.3-133.5 142.9 13.6 26.4 -0.7 40 336 A A E -CD 23 49A 0 -17,-2.3 -17,-2.5 -2,-0.4 2,-0.4 -0.996 1.4-169.7-136.7 141.6 10.6 24.1 -0.5 41 337 A V E -CD 22 48A 0 7,-2.5 7,-2.9 -2,-0.4 2,-0.5 -0.998 3.3-176.4-133.4 130.1 6.9 24.8 -1.4 42 338 A V E +CD 21 47A 5 -21,-2.4 -21,-3.0 -2,-0.4 2,-0.2 -0.991 23.5 139.0-127.7 122.8 3.9 22.6 -0.6 43 339 A N E > - D 0 46A 5 3,-2.3 3,-1.4 -2,-0.5 -23,-0.1 -0.764 68.5 -68.1-144.1-169.2 0.5 23.6 -1.9 44 340 A E T 3 S+ 0 0 147 -25,-0.5 3,-0.1 1,-0.3 -24,-0.1 0.727 127.9 55.0 -62.2 -21.0 -2.6 22.0 -3.5 45 341 A H T 3 S- 0 0 90 -31,-0.3 2,-0.3 1,-0.3 -1,-0.3 0.616 118.7 -89.6 -88.8 -13.4 -0.7 21.3 -6.7 46 342 A G E < - D 0 43A 26 -3,-1.4 -3,-2.3 -32,-0.1 2,-0.4 -0.953 50.8 -47.2 143.2-162.6 2.1 19.3 -5.0 47 343 A R E - D 0 42A 91 -2,-0.3 -41,-2.7 -5,-0.2 2,-0.3 -0.943 48.3-177.8-117.8 134.3 5.5 19.5 -3.4 48 344 A F E -aD 6 41A 4 -7,-2.9 -7,-2.5 -2,-0.4 2,-0.4 -0.970 18.6-157.9-136.3 148.9 8.5 21.4 -4.8 49 345 A F E -aD 7 40A 3 -43,-2.6 -41,-1.4 -2,-0.3 2,-0.4 -0.977 16.8-171.4-120.4 134.7 12.1 22.0 -4.1 50 346 A L E -aD 8 39A 0 -11,-2.8 -11,-1.9 -2,-0.4 -41,-0.1 -0.986 25.3-123.3-129.6 138.4 13.9 25.1 -5.5 51 347 A R >> - 0 0 53 -43,-0.5 4,-2.4 -2,-0.4 3,-0.8 -0.615 26.7-130.3 -75.4 136.9 17.5 26.1 -5.5 52 348 A P H 3> S+ 0 0 19 0, 0.0 4,-2.6 0, 0.0 5,-0.3 0.891 104.7 56.4 -56.8 -45.3 17.8 29.5 -3.9 53 349 A E H 34 S+ 0 0 128 1,-0.2 4,-0.2 2,-0.2 -2,-0.0 0.809 115.0 42.9 -58.7 -26.5 20.0 31.1 -6.6 54 350 A T H X> S+ 0 0 43 -3,-0.8 3,-1.0 2,-0.1 4,-0.6 0.963 118.7 38.3 -81.2 -61.4 17.2 30.1 -9.0 55 351 A A H >< S+ 0 0 0 -4,-2.4 3,-1.2 1,-0.2 7,-0.3 0.894 114.5 53.1 -59.2 -46.3 14.1 31.1 -7.1 56 352 A L T 3< S+ 0 0 27 -4,-2.6 -1,-0.2 1,-0.3 -3,-0.1 0.599 109.9 49.5 -70.0 -9.5 15.4 34.2 -5.5 57 353 A A T <4 S+ 0 0 76 -3,-1.0 -1,-0.3 -5,-0.3 -2,-0.2 0.494 88.9 101.0-102.9 -8.2 16.4 35.6 -8.9 58 354 A D S+ 0 0 91 0, 0.0 4,-2.1 0, 0.0 5,-0.2 0.851 96.3 49.7 -52.2 -41.8 10.8 37.9 -10.7 60 356 A Q H > S+ 0 0 101 2,-0.2 4,-2.3 1,-0.2 5,-0.1 0.913 111.7 47.4 -67.5 -42.9 7.6 35.9 -10.3 61 357 A F H > S+ 0 0 0 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.924 112.0 49.9 -64.4 -44.6 8.8 34.1 -7.2 62 358 A V H X S+ 0 0 46 -4,-2.7 4,-2.0 -7,-0.3 -1,-0.2 0.914 111.5 48.7 -60.8 -42.8 10.0 37.3 -5.6 63 359 A A H X S+ 0 0 64 -4,-2.1 4,-0.8 -5,-0.2 -1,-0.2 0.910 109.6 52.7 -63.1 -41.6 6.7 38.9 -6.3 64 360 A W H >< S+ 0 0 8 -4,-2.3 3,-0.8 1,-0.2 6,-0.2 0.913 107.9 52.0 -59.3 -43.8 4.9 35.9 -4.9 65 361 A L H 3< S+ 0 0 1 -4,-2.4 27,-3.0 1,-0.2 -1,-0.2 0.900 114.3 42.2 -59.0 -43.7 7.0 36.2 -1.7 66 362 A G H 3< S+ 0 0 25 -4,-2.0 2,-0.8 25,-0.2 -1,-0.2 0.464 88.1 105.2 -85.9 -1.6 6.1 39.8 -1.3 67 363 A D X< - 0 0 57 -4,-0.8 3,-1.9 -3,-0.8 25,-0.1 -0.718 55.9-160.0 -85.1 109.5 2.4 39.5 -2.1 68 364 A E T 3 S+ 0 0 107 -2,-0.8 -1,-0.2 1,-0.3 -4,-0.0 0.716 89.1 61.5 -59.5 -23.2 0.4 39.8 1.1 69 365 A T T 3 S+ 0 0 93 1,-0.1 2,-0.9 2,-0.1 -1,-0.3 0.562 86.3 80.8 -83.5 -7.4 -2.6 38.0 -0.5 70 366 A K S < S- 0 0 60 -3,-1.9 2,-0.3 -6,-0.2 -51,-0.2 -0.880 82.6-144.1 -99.3 105.1 -0.6 34.9 -1.2 71 367 A K E -b 19 0A 73 -53,-2.4 -51,-2.0 -2,-0.9 2,-0.4 -0.551 16.7-168.5 -80.0 131.7 -0.7 33.1 2.2 72 368 A K E -be 20 94A 0 21,-2.4 23,-1.8 -2,-0.3 24,-1.2 -0.914 12.7-154.4-119.6 143.4 2.2 31.1 3.5 73 369 A S E +be 21 96A 0 -53,-2.5 -51,-2.6 -2,-0.4 2,-0.2 -0.973 33.0 157.3-114.4 127.1 2.5 28.7 6.5 74 370 A M E - e 0 97A 3 22,-2.8 24,-3.3 -2,-0.5 2,-0.4 -0.766 43.6-116.8-139.6-178.3 6.0 28.5 7.9 75 371 A F S S- 0 0 34 -53,-0.4 39,-0.1 22,-0.2 22,-0.1 -0.982 98.7 -4.5-128.2 115.8 8.1 27.6 10.9 76 372 A D S >> S- 0 0 32 -2,-0.4 4,-1.1 3,-0.1 3,-0.5 0.989 71.9-179.9 64.3 62.5 10.1 30.5 12.4 77 373 A S H 3> S+ 0 0 11 1,-0.2 4,-3.1 2,-0.2 5,-0.2 0.772 74.1 66.8 -65.5 -25.0 9.1 33.0 9.7 78 374 A K H 3> S+ 0 0 10 2,-0.2 4,-2.9 1,-0.2 5,-0.3 0.914 97.7 53.8 -62.5 -40.4 11.3 35.7 11.3 79 375 A R H <> S+ 0 0 54 -3,-0.5 4,-2.2 1,-0.2 -1,-0.2 0.941 114.4 40.4 -57.0 -49.2 14.4 33.7 10.5 80 376 A A H X S+ 0 0 3 -4,-1.1 4,-2.3 2,-0.2 -2,-0.2 0.905 114.0 53.5 -67.3 -43.3 13.4 33.6 6.8 81 377 A A H X S+ 0 0 16 -4,-3.1 4,-2.3 1,-0.2 -2,-0.2 0.924 112.6 43.3 -59.6 -46.4 12.1 37.2 6.8 82 378 A V H X S+ 0 0 0 -4,-2.9 4,-2.1 2,-0.2 -49,-0.3 0.927 112.6 50.7 -66.7 -45.7 15.4 38.6 8.1 83 379 A A H < S+ 0 0 1 -4,-2.2 4,-0.4 -5,-0.3 -1,-0.2 0.882 114.2 47.0 -60.1 -35.9 17.6 36.4 5.9 84 380 A L H ><>S+ 0 0 0 -4,-2.3 5,-2.5 -5,-0.2 3,-1.3 0.887 105.4 58.7 -72.2 -37.4 15.5 37.7 3.0 85 381 A K H ><5S+ 0 0 55 -4,-2.3 3,-1.8 1,-0.3 -2,-0.2 0.892 101.0 56.1 -58.2 -40.0 15.7 41.3 4.2 86 382 A W T 3<5S+ 0 0 52 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.713 108.2 48.9 -66.0 -18.1 19.5 41.1 3.9 87 383 A K T < 5S- 0 0 105 -3,-1.3 -1,-0.3 -4,-0.4 -2,-0.2 0.281 121.9-108.0-101.6 8.1 19.1 40.1 0.3 88 384 A G T < 5S+ 0 0 72 -3,-1.8 2,-0.4 1,-0.2 -3,-0.2 0.775 78.2 129.7 72.3 27.7 16.7 42.9 -0.4 89 385 A I < - 0 0 19 -5,-2.5 2,-0.4 -8,-0.1 -1,-0.2 -0.961 49.4-142.6-119.9 129.5 13.6 40.7 -0.6 90 386 A E - 0 0 131 -2,-0.4 2,-0.6 -28,-0.1 -23,-0.1 -0.743 7.4-154.7 -92.6 132.2 10.4 41.3 1.3 91 387 A L + 0 0 24 -2,-0.4 2,-0.3 -10,-0.1 -25,-0.2 -0.930 25.7 163.6-106.9 119.9 8.4 38.3 2.7 92 388 A C + 0 0 21 -27,-3.0 -25,-0.2 -2,-0.6 3,-0.1 -0.818 41.9 47.3-129.9 170.4 4.7 39.0 3.2 93 389 A G + 0 0 2 -2,-0.3 -21,-2.4 1,-0.2 2,-0.9 0.675 55.6 159.2 75.9 18.1 1.5 37.0 3.8 94 390 A V E +e 72 0A 36 -23,-0.2 -1,-0.2 1,-0.2 -21,-0.2 -0.653 6.1 168.9 -76.0 109.5 2.7 34.7 6.5 95 391 A S E + 0 0 43 -23,-1.8 2,-0.3 -2,-0.9 -22,-0.2 0.550 62.1 31.1 -99.2 -9.0 -0.6 33.7 8.0 96 392 A F E -e 73 0A 0 -24,-1.2 -22,-2.8 87,-0.1 2,-0.6 -0.938 55.6-170.4-153.9 126.8 0.6 30.8 10.2 97 393 A D E > -e 74 0A 1 -2,-0.3 4,-2.2 -24,-0.2 -22,-0.2 -0.947 8.7-161.8-120.7 109.1 3.9 30.2 12.0 98 394 A L H > S+ 0 0 0 -24,-3.3 4,-2.6 -2,-0.6 5,-0.2 0.799 89.6 57.6 -59.2 -32.7 4.2 26.7 13.5 99 395 A L H > S+ 0 0 20 -25,-0.3 4,-2.3 2,-0.2 -1,-0.2 0.950 111.3 41.0 -64.3 -48.5 7.0 27.7 15.9 100 396 A L H > S+ 0 0 3 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.866 114.6 53.5 -67.7 -34.9 4.9 30.4 17.5 101 397 A A H X S+ 0 0 0 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.947 111.7 44.0 -63.7 -49.2 1.9 28.1 17.5 102 398 A A H X S+ 0 0 0 -4,-2.6 4,-1.8 1,-0.2 -2,-0.2 0.897 111.7 55.3 -62.5 -40.9 3.7 25.3 19.3 103 399 A Y H < S+ 0 0 10 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.913 109.4 45.5 -59.5 -45.4 5.3 27.9 21.7 104 400 A L H < S+ 0 0 1 -4,-2.2 370,-0.5 1,-0.2 -1,-0.2 0.877 109.5 55.4 -68.2 -36.7 1.9 29.2 22.7 105 401 A L H < S- 0 0 2 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.851 137.2 -13.4 -65.1 -35.2 0.4 25.7 23.1 106 402 A D >< - 0 0 28 -4,-1.8 3,-1.6 -5,-0.1 5,-0.4 -0.469 55.6-174.3-170.3 92.2 3.2 24.7 25.6 107 403 A P G > S+ 0 0 11 0, 0.0 3,-0.8 0, 0.0 -3,-0.1 0.680 84.7 70.0 -64.0 -16.8 6.4 26.8 26.0 108 404 A A G 3 S+ 0 0 53 1,-0.2 -5,-0.1 -5,-0.1 208,-0.1 0.715 82.0 72.2 -74.0 -20.8 7.8 24.1 28.3 109 405 A Q G < S- 0 0 117 -3,-1.6 -1,-0.2 -7,-0.2 3,-0.1 0.750 92.3-142.4 -66.8 -22.0 8.2 21.7 25.4 110 406 A G < - 0 0 45 -3,-0.8 2,-0.2 -4,-0.3 -2,-0.1 0.869 23.0-168.1 63.0 36.3 11.1 23.7 24.1 111 407 A V + 0 0 14 -5,-0.4 -1,-0.2 1,-0.2 3,-0.1 -0.409 22.6 157.9 -60.5 120.7 10.0 23.2 20.5 112 408 A D + 0 0 124 -2,-0.2 2,-0.3 1,-0.2 -1,-0.2 0.276 57.7 33.1-130.5 9.5 12.9 24.3 18.3 113 409 A D S > S- 0 0 11 1,-0.1 4,-1.7 -14,-0.1 3,-0.4 -0.973 84.6-102.8-156.4 162.2 12.4 22.5 15.0 114 410 A V H > S+ 0 0 2 -2,-0.3 4,-3.1 1,-0.2 5,-0.2 0.881 117.9 58.3 -54.8 -41.1 9.5 21.2 12.9 115 411 A A H > S+ 0 0 14 12,-0.3 4,-2.1 1,-0.2 -1,-0.2 0.899 105.4 49.2 -57.9 -42.8 10.1 17.7 14.0 116 412 A A H > S+ 0 0 36 -3,-0.4 4,-0.6 2,-0.2 -1,-0.2 0.888 113.5 45.7 -65.4 -40.0 9.6 18.6 17.7 117 413 A A H >< S+ 0 0 0 -4,-1.7 3,-1.3 1,-0.2 4,-0.4 0.936 112.0 52.4 -67.1 -45.4 6.3 20.5 16.9 118 414 A A H ><>S+ 0 0 0 -4,-3.1 5,-2.2 1,-0.3 3,-1.8 0.858 99.4 62.2 -59.2 -38.0 5.1 17.7 14.7 119 415 A K H ><5S+ 0 0 116 -4,-2.1 3,-1.6 1,-0.3 -1,-0.3 0.758 89.9 70.6 -62.2 -21.6 5.7 15.1 17.5 120 416 A M T <<5S+ 0 0 50 -3,-1.3 -1,-0.3 -4,-0.6 -2,-0.2 0.786 106.9 37.1 -64.5 -26.7 3.1 17.1 19.6 121 417 A K T < 5S- 0 0 62 -3,-1.8 -1,-0.3 -4,-0.4 -2,-0.2 -0.076 122.1-103.7-115.1 30.7 0.5 15.7 17.2 122 418 A Q T < 5S+ 0 0 158 -3,-1.6 2,-0.6 1,-0.2 -3,-0.2 0.807 76.2 140.7 52.0 35.4 2.0 12.3 16.7 123 419 A Y < + 0 0 46 -5,-2.2 -1,-0.2 -8,-0.1 -2,-0.2 -0.947 14.5 159.9-108.0 118.4 3.3 13.2 13.3 124 420 A E + 0 0 124 -2,-0.6 2,-0.7 -3,-0.1 -1,-0.1 0.148 34.1 112.6-128.1 21.2 6.8 11.8 12.8 125 421 A A S S+ 0 0 41 28,-0.1 2,-0.3 -7,-0.1 32,-0.1 -0.191 71.5 68.7 -88.3 44.3 7.4 11.8 9.0 126 422 A V S S- 0 0 13 -2,-0.7 24,-0.1 -11,-0.1 -3,-0.0 -0.949 79.0-124.4-159.6 138.5 10.1 14.4 9.3 127 423 A R - 0 0 114 -2,-0.3 -12,-0.3 1,-0.1 -13,-0.1 -0.516 31.7-102.3 -87.4 153.0 13.6 14.3 10.8 128 424 A P > - 0 0 64 0, 0.0 4,-1.1 0, 0.0 3,-0.4 -0.457 33.3-119.4 -68.7 149.2 14.9 16.6 13.6 129 425 A D H >> S+ 0 0 33 1,-0.2 4,-3.1 2,-0.2 3,-0.5 0.884 112.6 57.3 -56.9 -40.8 17.2 19.3 12.1 130 426 A E H 3> S+ 0 0 108 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.879 101.6 55.6 -59.8 -37.9 20.1 18.1 14.2 131 427 A A H 34 S+ 0 0 60 -3,-0.4 -1,-0.2 1,-0.2 -2,-0.2 0.833 115.7 38.7 -64.7 -30.5 19.9 14.6 12.7 132 428 A V H << S+ 0 0 15 -4,-1.1 -2,-0.2 -3,-0.5 -1,-0.2 0.890 129.6 27.3 -86.1 -42.8 20.2 16.1 9.2 133 429 A Y H < S- 0 0 5 -4,-3.1 7,-2.3 1,-0.2 -3,-0.2 0.578 96.2-142.5 -97.7 -12.2 22.7 18.9 9.8 134 430 A G < - 0 0 25 -4,-2.7 2,-0.3 -5,-0.4 -1,-0.2 -0.198 23.8 -88.3 75.1-175.1 24.7 17.4 12.7 135 431 A K S > S- 0 0 140 4,-0.1 3,-1.4 -4,-0.1 4,-0.1 -0.958 70.4 -12.0-137.8 155.4 26.0 19.6 15.6 136 432 A G G > S- 0 0 63 -2,-0.3 3,-2.0 1,-0.3 0, 0.0 -0.275 125.1 -5.7 63.0-141.8 29.0 21.6 16.5 137 433 A A G 3 S+ 0 0 115 1,-0.3 -1,-0.3 3,-0.0 -3,-0.0 0.671 137.4 55.5 -60.7 -18.3 32.2 21.3 14.4 138 434 A K G < S+ 0 0 186 -3,-1.4 -1,-0.3 2,-0.0 -2,-0.2 0.484 79.0 121.7 -94.0 -3.5 30.5 18.5 12.5 139 435 A R < + 0 0 82 -3,-2.0 2,-0.3 -5,-0.1 -5,-0.2 -0.312 36.1 148.0 -60.2 139.5 27.5 20.6 11.5 140 436 A A - 0 0 61 -7,-2.3 -2,-0.0 -6,-0.1 -3,-0.0 -0.948 52.2-102.4-172.6 151.6 27.1 20.8 7.7 141 437 A V - 0 0 69 -2,-0.3 3,-0.1 1,-0.1 -8,-0.1 -0.703 46.0-135.0 -81.5 123.1 24.6 21.1 4.8 142 438 A P - 0 0 31 0, 0.0 -1,-0.1 0, 0.0 5,-0.1 -0.136 34.9 -67.8 -73.5 172.7 24.2 17.7 3.2 143 439 A D >> - 0 0 132 1,-0.1 4,-2.6 4,-0.1 3,-0.7 -0.193 56.5 -99.7 -58.0 152.6 24.1 16.8 -0.5 144 440 A E H 3> S+ 0 0 66 1,-0.2 4,-3.3 2,-0.2 5,-0.3 0.799 119.4 55.7 -45.2 -44.6 21.1 18.2 -2.5 145 441 A P H 3> S+ 0 0 93 0, 0.0 4,-1.7 0, 0.0 -1,-0.2 0.933 114.6 39.7 -58.7 -44.2 19.1 14.9 -2.5 146 442 A V H <> S+ 0 0 63 -3,-0.7 4,-1.8 2,-0.2 -2,-0.2 0.925 118.2 47.8 -70.0 -45.3 19.2 14.7 1.3 147 443 A L H X S+ 0 0 10 -4,-2.6 4,-2.5 1,-0.2 5,-0.2 0.928 111.2 51.1 -60.5 -47.7 18.7 18.4 1.8 148 444 A A H X S+ 0 0 0 -4,-3.3 4,-2.1 -5,-0.2 -1,-0.2 0.894 109.4 48.9 -59.0 -45.6 15.8 18.5 -0.7 149 445 A E H X S+ 0 0 59 -4,-1.7 4,-2.3 -5,-0.3 -1,-0.2 0.877 111.5 50.7 -64.2 -37.7 13.9 15.7 0.9 150 446 A H H X S+ 0 0 3 -4,-1.8 4,-2.1 2,-0.2 -2,-0.2 0.951 111.1 46.2 -65.7 -49.3 14.3 17.2 4.4 151 447 A L H X S+ 0 0 0 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.876 113.9 49.7 -62.3 -37.0 13.0 20.6 3.4 152 448 A V H X S+ 0 0 0 -4,-2.1 4,-2.8 -5,-0.2 -1,-0.2 0.921 110.1 49.9 -67.6 -42.9 10.1 19.1 1.5 153 449 A R H X S+ 0 0 38 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.851 110.5 50.6 -64.5 -33.3 9.2 16.9 4.5 154 450 A K H X S+ 0 0 9 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.916 112.4 46.2 -70.3 -39.8 9.3 19.9 6.8 155 451 A A H X S+ 0 0 0 -4,-2.1 4,-2.7 1,-0.2 -2,-0.2 0.890 111.5 52.8 -66.1 -40.2 7.0 21.8 4.4 156 452 A A H X S+ 0 0 7 -4,-2.8 4,-2.0 2,-0.2 -1,-0.2 0.893 109.4 48.6 -62.7 -41.6 4.7 18.8 4.2 157 453 A A H X S+ 0 0 0 -4,-2.1 4,-3.1 2,-0.2 5,-0.2 0.932 111.5 49.1 -65.0 -45.7 4.5 18.7 8.0 158 454 A I H X S+ 0 0 1 -4,-2.3 4,-1.6 1,-0.2 -2,-0.2 0.934 110.4 52.0 -58.4 -45.4 3.7 22.4 8.2 159 455 A W H < S+ 0 0 90 -4,-2.7 4,-0.4 1,-0.2 -1,-0.2 0.892 116.8 39.3 -56.9 -42.8 1.0 21.9 5.5 160 456 A E H < S+ 0 0 113 -4,-2.0 3,-0.3 1,-0.2 -2,-0.2 0.835 115.6 49.8 -77.5 -36.7 -0.5 19.0 7.5 161 457 A L H X S+ 0 0 3 -4,-3.1 4,-2.3 1,-0.2 5,-0.3 0.628 85.4 84.5 -82.7 -16.2 -0.2 20.5 11.0 162 458 A E H X S+ 0 0 24 -4,-1.6 4,-2.7 -5,-0.2 5,-0.2 0.939 92.0 48.1 -51.6 -52.9 -1.6 23.9 10.5 163 459 A R H > S+ 0 0 139 -4,-0.4 4,-2.5 -3,-0.3 -1,-0.2 0.951 113.3 43.6 -56.8 -57.7 -5.2 22.8 11.0 164 460 A P H > S+ 0 0 37 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.852 115.3 49.9 -60.2 -33.6 -4.8 20.7 14.2 165 461 A F H X S+ 0 0 0 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.934 112.1 46.7 -69.9 -44.0 -2.6 23.4 15.8 166 462 A L H X S+ 0 0 30 -4,-2.7 4,-2.3 -5,-0.3 -1,-0.2 0.875 110.7 54.8 -64.1 -35.8 -5.1 26.2 15.0 167 463 A D H X S+ 0 0 66 -4,-2.5 4,-2.0 -5,-0.2 -1,-0.2 0.914 110.6 43.5 -64.6 -42.8 -7.9 24.0 16.3 168 464 A E H X S+ 0 0 42 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.913 111.6 53.5 -70.3 -40.5 -6.2 23.5 19.7 169 465 A L H <>S+ 0 0 0 -4,-2.5 5,-3.4 1,-0.2 6,-0.6 0.929 109.2 50.2 -57.7 -43.5 -5.2 27.1 19.9 170 466 A R H ><5S+ 0 0 160 -4,-2.3 3,-1.5 4,-0.2 -1,-0.2 0.923 108.6 51.4 -60.4 -44.3 -8.9 28.0 19.3 171 467 A R H 3<5S+ 0 0 163 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.874 111.4 48.2 -59.4 -37.4 -10.0 25.6 22.1 172 468 A N T 3<5S- 0 0 21 -4,-2.3 -1,-0.3 -5,-0.1 -2,-0.2 0.431 115.4-118.5 -82.0 -0.5 -7.4 27.3 24.4 173 469 A E T < 5S+ 0 0 129 -3,-1.5 -3,-0.2 -4,-0.3 4,-0.2 0.846 85.2 117.1 63.1 34.6 -8.8 30.7 23.4 174 470 A Q >< + 0 0 0 -5,-3.4 4,-1.9 -6,-0.2 -4,-0.2 0.264 33.6 100.8-113.7 7.8 -5.3 31.5 22.0 175 471 A D H > S+ 0 0 37 -6,-0.6 4,-2.4 1,-0.2 5,-0.2 0.918 88.5 42.6 -61.5 -43.8 -6.2 31.9 18.4 176 472 A R H >>S+ 0 0 155 1,-0.2 4,-2.9 2,-0.2 5,-0.8 0.844 107.5 62.2 -70.0 -33.1 -6.1 35.7 18.6 177 473 A L H >>S+ 0 0 8 3,-0.2 5,-2.5 2,-0.2 4,-0.7 0.912 112.7 37.0 -58.2 -41.1 -3.0 35.5 20.7 178 474 A L H <>S+ 0 0 0 -4,-1.9 5,-2.7 3,-0.2 -2,-0.2 0.979 125.7 35.3 -73.5 -58.5 -1.2 33.9 17.8 179 475 A V H <5S+ 0 0 71 -4,-2.4 -3,-0.2 1,-0.2 -2,-0.2 0.801 128.5 32.1 -69.2 -33.8 -2.8 35.8 14.9 180 476 A E H <5S+ 0 0 99 -4,-2.9 -3,-0.2 -5,-0.2 -1,-0.2 0.650 132.2 19.2-102.0 -16.1 -3.1 39.2 16.5 181 477 A L T X S+ 0 0 44 0, 0.0 4,-1.4 0, 0.0 3,-0.4 0.924 113.3 52.9 -64.4 -37.5 2.4 40.6 14.0 185 481 A L H X S+ 0 0 0 -4,-2.2 4,-3.0 1,-0.2 5,-0.2 0.859 99.6 63.4 -61.8 -36.2 5.1 41.0 16.6 186 482 A S H X S+ 0 0 3 -4,-2.1 4,-2.0 1,-0.2 -1,-0.2 0.894 103.1 48.2 -55.6 -42.5 7.4 38.6 14.8 187 483 A S H X S+ 0 0 73 -4,-1.2 4,-1.7 -3,-0.4 -1,-0.2 0.852 111.5 49.9 -67.0 -36.4 7.4 41.0 11.8 188 484 A I H X S+ 0 0 15 -4,-1.4 4,-2.2 2,-0.2 -2,-0.2 0.910 109.9 50.0 -68.9 -42.5 8.2 44.0 14.1 189 485 A L H X S+ 0 0 0 -4,-3.0 4,-2.7 1,-0.2 5,-0.2 0.889 107.1 56.2 -62.8 -37.8 11.1 42.0 15.7 190 486 A A H X S+ 0 0 2 -4,-2.0 4,-2.4 -5,-0.2 -1,-0.2 0.918 108.1 47.5 -59.4 -45.2 12.4 41.2 12.2 191 487 A E H X S+ 0 0 97 -4,-1.7 4,-2.6 2,-0.2 -1,-0.2 0.912 112.4 49.4 -62.6 -43.0 12.6 44.9 11.4 192 488 A M H X S+ 0 0 4 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.925 112.8 45.9 -63.4 -47.0 14.3 45.7 14.7 193 489 A E H < S+ 0 0 0 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.927 114.5 48.2 -61.5 -47.1 16.9 43.0 14.3 194 490 A F H < S+ 0 0 75 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.902 111.2 50.1 -62.0 -43.2 17.6 43.9 10.7 195 491 A A H < S- 0 0 23 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.941 94.5-176.6 -60.5 -47.4 17.9 47.7 11.5 196 492 A G < - 0 0 3 -4,-2.4 2,-0.4 -5,-0.2 111,-0.2 -0.065 28.6 -80.3 75.1 179.9 20.3 46.9 14.3 197 493 A V E -F 306 0B 7 109,-2.2 109,-2.2 -4,-0.1 2,-0.1 -0.992 38.3-123.6-126.5 127.2 21.9 49.3 16.8 198 494 A K E -FG 305 345B 62 147,-0.6 147,-2.0 -2,-0.4 2,-0.4 -0.438 26.2-154.9 -69.5 137.9 24.9 51.5 15.9 199 495 A V E - G 0 344B 5 105,-3.1 2,-1.5 145,-0.2 145,-0.2 -0.953 17.9-137.1-121.3 135.7 28.0 51.1 18.2 200 496 A D > + 0 0 63 143,-3.1 4,-1.9 -2,-0.4 5,-0.2 -0.706 29.0 178.2 -87.0 85.3 30.7 53.6 18.8 201 497 A T H > S+ 0 0 18 -2,-1.5 4,-2.8 1,-0.2 -1,-0.2 0.827 74.4 58.1 -61.7 -34.2 33.6 51.1 18.7 202 498 A K H > S+ 0 0 143 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.943 107.2 48.9 -61.7 -44.4 36.3 53.7 19.2 203 499 A R H > S+ 0 0 77 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.935 112.5 47.5 -59.1 -47.9 34.7 54.6 22.5 204 500 A L H X S+ 0 0 0 -4,-1.9 4,-2.2 1,-0.2 -1,-0.2 0.889 110.8 52.3 -61.0 -40.7 34.4 50.9 23.5 205 501 A E H X S+ 0 0 90 -4,-2.8 4,-1.7 2,-0.2 -1,-0.2 0.866 108.6 50.2 -64.7 -36.3 38.1 50.4 22.5 206 502 A Q H X S+ 0 0 69 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.935 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111.0 44.7 -58.7 -50.0 46.8 45.2 35.6 217 513 A T H X S+ 0 0 98 -4,-1.9 4,-1.9 1,-0.2 -2,-0.2 0.932 117.0 44.5 -60.6 -49.4 47.3 47.2 38.7 218 514 A V H X S+ 0 0 11 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.898 111.0 55.2 -63.2 -41.1 44.6 45.3 40.7 219 515 A E H X S+ 0 0 57 -4,-3.1 4,-2.0 1,-0.2 -1,-0.2 0.934 109.7 45.2 -57.5 -49.5 45.9 42.0 39.4 220 516 A Q H X S+ 0 0 104 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.866 110.6 54.6 -63.2 -37.2 49.5 42.7 40.7 221 517 A R H X S+ 0 0 73 -4,-1.9 4,-2.6 1,-0.2 -1,-0.2 0.889 107.0 51.9 -63.5 -39.3 48.1 44.0 44.0 222 518 A I H X S+ 0 0 0 -4,-2.3 4,-2.1 2,-0.2 6,-0.2 0.913 110.5 46.1 -64.3 -44.3 46.2 40.7 44.4 223 519 A Y H X>S+ 0 0 28 -4,-2.0 4,-1.5 2,-0.2 5,-1.2 0.873 112.5 53.1 -66.0 -35.6 49.4 38.6 43.8 224 520 A E H <5S+ 0 0 127 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.925 112.9 42.0 -63.7 -46.2 51.2 40.9 46.2 225 521 A L H <5S+ 0 0 33 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.783 116.6 48.8 -72.7 -27.7 48.6 40.4 48.9 226 522 A A H <5S- 0 0 3 -4,-2.1 -1,-0.2 2,-0.2 -2,-0.2 0.674 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208,-0.4 1,-0.2 5,-0.1 -0.829 79.5 -27.4 -92.6 114.6 7.0 52.2 35.9 360 656 A Q S > S+ 0 0 57 -2,-0.7 4,-1.9 1,-0.1 -1,-0.2 0.877 79.1 163.9 49.2 48.7 6.3 49.1 38.1 361 657 A I H > S+ 0 0 2 -3,-0.3 4,-2.6 1,-0.2 5,-0.2 0.911 70.0 55.1 -63.4 -37.9 4.2 47.4 35.5 362 658 A E H > S+ 0 0 13 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.926 110.5 42.9 -61.1 -47.0 4.4 44.0 37.3 363 659 A L H > S+ 0 0 1 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.820 113.6 52.9 -69.7 -29.6 3.1 45.3 40.7 364 660 A R H X S+ 0 0 4 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.902 109.4 48.9 -70.4 -39.4 0.4 47.3 38.8 365 661 A V H X S+ 0 0 2 -4,-2.6 4,-3.0 2,-0.2 5,-0.3 0.922 110.3 51.6 -63.5 -42.7 -0.7 44.1 37.0 366 662 A L H X S+ 0 0 1 -4,-2.3 4,-2.5 1,-0.2 5,-0.3 0.907 107.6 51.9 -60.3 -42.0 -0.7 42.3 40.4 367 663 A A H X>S+ 0 0 0 -4,-2.1 4,-1.3 1,-0.2 5,-0.8 0.919 113.4 46.7 -60.1 -42.2 -3.0 45.1 41.8 368 664 A H H <5S+ 0 0 24 -4,-2.1 -2,-0.2 2,-0.2 -1,-0.2 0.946 115.8 40.7 -65.1 -53.5 -5.3 44.5 38.9 369 665 A I H <5S+ 0 0 44 -4,-3.0 -2,-0.2 1,-0.2 -1,-0.2 0.857 123.1 39.7 -68.4 -34.6 -5.5 40.7 38.9 370 666 A A H <5S- 0 0 5 -4,-2.5 -1,-0.2 -5,-0.3 -2,-0.2 0.646 94.1-143.4 -87.5 -16.0 -5.7 40.4 42.7 371 667 A E T <5 + 0 0 94 -4,-1.3 2,-0.6 -5,-0.3 -3,-0.2 0.904 30.0 179.3 52.3 44.2 -8.0 43.4 43.0 372 668 A D >< - 0 0 2 -5,-0.8 4,-2.8 -6,-0.3 5,-0.3 -0.678 23.1-149.5 -79.5 118.2 -6.2 44.3 46.2 373 669 A D H > S+ 0 0 130 -2,-0.6 4,-2.3 1,-0.2 5,-0.2 0.898 93.5 47.1 -55.4 -46.2 -7.8 47.5 47.5 374 670 A N H > S+ 0 0 43 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.926 115.2 44.3 -64.2 -46.4 -4.7 48.8 49.2 375 671 A L H > S+ 0 0 0 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.906 113.7 50.2 -67.4 -40.8 -2.4 48.2 46.3 376 672 A M H X S+ 0 0 11 -4,-2.8 4,-2.4 1,-0.2 -2,-0.2 0.944 111.9 48.1 -62.1 -46.0 -4.8 49.6 43.8 377 673 A E H X S+ 0 0 75 -4,-2.3 4,-1.8 -5,-0.3 -1,-0.2 0.889 107.4 56.9 -60.9 -40.0 -5.3 52.7 45.8 378 674 A A H <>S+ 0 0 2 -4,-2.2 5,-2.4 1,-0.2 -1,-0.2 0.937 112.7 40.3 -57.6 -46.4 -1.5 53.1 46.2 379 675 A F H ><5S+ 0 0 4 -4,-2.1 3,-0.9 1,-0.2 -1,-0.2 0.825 108.6 59.3 -74.4 -30.2 -1.1 53.1 42.4 380 676 A R H 3<5S+ 0 0 133 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.828 111.3 43.4 -66.3 -27.6 -4.2 55.3 41.8 381 677 A R T 3<5S- 0 0 154 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.440 110.7-129.4 -91.6 -2.4 -2.4 57.9 44.0 382 678 A D T < 5 + 0 0 77 -3,-0.9 -3,-0.2 -5,-0.1 -4,-0.1 0.886 44.6 176.7 53.1 43.6 0.9 57.1 42.1 383 679 A L < - 0 0 56 -5,-2.4 2,-0.9 -6,-0.2 -1,-0.1 -0.284 46.2 -94.3 -73.3 159.3 2.7 56.6 45.5 384 680 A D > - 0 0 78 1,-0.2 4,-2.5 2,-0.1 5,-0.2 -0.697 43.1-153.5 -72.2 112.4 6.3 55.5 45.8 385 681 A I H > S+ 0 0 6 -2,-0.9 4,-2.4 1,-0.2 -1,-0.2 0.813 87.3 51.9 -65.2 -30.7 5.4 51.8 46.1 386 682 A H H > S+ 0 0 17 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.928 112.9 44.5 -72.0 -42.0 8.5 50.8 48.0 387 683 A T H > S+ 0 0 24 2,-0.2 4,-2.7 1,-0.2 -2,-0.2 0.924 114.5 50.5 -64.9 -42.9 8.0 53.6 50.6 388 684 A K H X S+ 0 0 29 -4,-2.5 4,-1.9 1,-0.2 -2,-0.2 0.915 110.0 49.4 -61.1 -43.6 4.3 52.7 50.8 389 685 A T H X S+ 0 0 0 -4,-2.4 4,-2.8 1,-0.2 5,-0.3 0.906 110.9 50.5 -63.0 -40.7 5.1 49.0 51.3 390 686 A A H X S+ 0 0 0 -4,-2.3 4,-2.5 1,-0.2 5,-0.2 0.938 107.0 54.5 -62.3 -47.4 7.5 49.9 54.1 391 687 A M H <>S+ 0 0 43 -4,-2.7 5,-2.0 1,-0.2 4,-0.3 0.890 115.5 39.0 -53.7 -42.5 4.9 52.1 55.8 392 688 A D H <5S+ 0 0 31 -4,-1.9 3,-0.4 3,-0.2 -2,-0.2 0.925 116.3 46.8 -76.6 -47.5 2.5 49.2 55.9 393 689 A I H <5S+ 0 0 7 -4,-2.8 -2,-0.2 1,-0.2 -3,-0.2 0.853 124.4 33.6 -64.7 -35.5 4.8 46.3 56.7 394 690 A F T <5S- 0 0 56 -4,-2.5 -1,-0.2 -5,-0.3 -2,-0.2 0.374 105.2-127.5-101.8 3.5 6.5 48.2 59.5 395 691 A Q T 5 + 0 0 138 -3,-0.4 2,-0.3 -4,-0.3 -3,-0.2 0.941 62.3 126.9 50.1 61.6 3.4 50.2 60.6 396 692 A V < - 0 0 34 -5,-2.0 -1,-0.2 -6,-0.2 -2,-0.1 -0.926 60.8-100.1-140.5 163.8 4.9 53.7 60.4 397 693 A S > - 0 0 53 -2,-0.3 3,-0.9 1,-0.1 4,-0.4 -0.300 42.5-100.9 -78.6 169.7 4.1 57.0 58.8 398 694 A E G > S+ 0 0 129 1,-0.3 3,-1.3 2,-0.2 -1,-0.1 0.891 124.2 54.5 -57.8 -41.5 5.8 58.2 55.6 399 695 A D G 3 S+ 0 0 155 1,-0.3 -1,-0.3 3,-0.0 0, 0.0 0.724 104.2 56.8 -64.8 -23.2 8.2 60.4 57.6 400 696 A E G < S+ 0 0 114 -3,-0.9 2,-0.6 2,-0.1 -1,-0.3 0.483 76.7 110.0 -88.9 -4.8 9.2 57.4 59.7 401 697 A V < - 0 0 27 -3,-1.3 -10,-0.0 -4,-0.4 -14,-0.0 -0.626 56.7-157.1 -75.7 116.2 10.4 55.3 56.8 402 698 A T > - 0 0 70 -2,-0.6 4,-2.2 1,-0.1 5,-0.2 -0.462 30.2-104.1 -88.2 164.6 14.2 55.1 57.0 403 699 A P H > S+ 0 0 116 0, 0.0 4,-2.1 0, 0.0 5,-0.1 0.888 122.7 49.4 -56.0 -39.1 16.5 54.3 54.0 404 700 A N H > S+ 0 0 78 2,-0.2 4,-2.1 1,-0.2 5,-0.2 0.857 107.4 54.5 -70.8 -33.1 17.0 50.7 55.3 405 701 A M H > S+ 0 0 30 2,-0.2 4,-2.3 -3,-0.2 5,-0.2 0.942 109.9 46.6 -63.5 -46.6 13.3 50.2 55.7 406 702 A R H X S+ 0 0 77 -4,-2.2 4,-2.9 1,-0.2 5,-0.2 0.914 109.5 54.8 -62.0 -42.9 12.6 51.2 52.1 407 703 A R H X S+ 0 0 119 -4,-2.1 4,-1.9 1,-0.2 -1,-0.2 0.928 111.2 44.4 -56.8 -46.9 15.4 49.0 50.9 408 704 A Q H X S+ 0 0 28 -4,-2.1 4,-1.8 2,-0.2 -1,-0.2 0.872 113.1 49.9 -68.5 -35.8 14.0 45.9 52.6 409 705 A A H X S+ 0 0 0 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.882 110.5 51.5 -68.3 -36.1 10.4 46.7 51.4 410 706 A K H X S+ 0 0 89 -4,-2.9 4,-2.1 1,-0.2 -2,-0.2 0.861 108.2 51.7 -66.6 -35.6 11.8 47.1 47.9 411 707 A A H X S+ 0 0 21 -4,-1.9 4,-2.1 2,-0.2 -1,-0.2 0.858 109.0 50.6 -68.8 -35.9 13.5 43.7 48.3 412 708 A V H X S+ 0 0 4 -4,-1.8 4,-1.4 2,-0.2 -2,-0.2 0.918 110.6 48.4 -67.5 -43.3 10.2 42.2 49.3 413 709 A N H X S+ 0 0 1 -4,-2.3 4,-2.6 1,-0.2 -2,-0.2 0.881 110.1 53.0 -63.5 -37.5 8.5 43.8 46.3 414 710 A F H X S+ 0 0 103 -4,-2.1 4,-2.5 1,-0.2 -1,-0.2 0.909 106.5 52.4 -62.5 -44.0 11.3 42.4 44.1 415 711 A G H <>S+ 0 0 9 -4,-2.1 5,-1.7 1,-0.2 4,-0.4 0.811 111.2 47.7 -62.6 -30.9 10.7 38.9 45.5 416 712 A I H ><5S+ 0 0 28 -4,-1.4 3,-0.5 3,-0.2 -2,-0.2 0.914 110.2 51.1 -76.2 -43.1 7.0 39.2 44.6 417 713 A V H 3<5S+ 0 0 10 -4,-2.6 -2,-0.2 1,-0.2 84,-0.2 0.898 123.3 29.9 -60.6 -41.9 7.7 40.5 41.1 418 714 A Y T 3<5S- 0 0 92 -4,-2.5 -1,-0.2 -5,-0.1 -2,-0.2 0.325 104.5-124.8-103.1 9.1 10.1 37.6 40.3 419 715 A G T < 5 + 0 0 18 -3,-0.5 2,-0.2 -4,-0.4 -3,-0.2 0.899 42.8 177.0 50.2 52.4 8.5 35.0 42.6 420 716 A I < - 0 0 42 -5,-1.7 -1,-0.2 -6,-0.1 5,-0.1 -0.576 33.2 -99.8 -87.1 150.5 11.6 34.1 44.5 421 717 A S > - 0 0 25 -2,-0.2 4,-1.7 1,-0.1 3,-0.4 -0.208 30.4-110.3 -63.9 157.0 11.6 31.7 47.4 422 718 A D H > S+ 0 0 62 1,-0.3 4,-0.7 2,-0.2 -1,-0.1 0.629 124.5 58.0 -63.0 -10.7 11.4 32.9 51.0 423 719 A Y H > S+ 0 0 133 2,-0.2 4,-2.1 1,-0.1 -1,-0.3 0.859 101.8 50.3 -83.6 -44.0 15.0 31.5 51.0 424 720 A G H > S+ 0 0 15 -3,-0.4 4,-1.8 1,-0.2 -2,-0.2 0.784 107.1 56.1 -65.6 -27.1 16.1 33.7 48.1 425 721 A L H X S+ 0 0 4 -4,-1.7 4,-2.2 2,-0.2 -1,-0.2 0.871 106.0 50.9 -71.2 -37.5 14.6 36.7 50.0 426 722 A A H X>S+ 0 0 2 -4,-0.7 5,-2.1 2,-0.2 4,-0.9 0.928 108.8 50.7 -64.7 -46.4 16.8 35.8 53.0 427 723 A Q H <5S+ 0 0 78 -4,-2.1 3,-0.4 1,-0.2 -2,-0.2 0.911 112.6 46.5 -58.5 -44.5 19.9 35.7 50.8 428 724 A N H <5S+ 0 0 98 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.870 120.0 37.9 -66.9 -39.2 19.2 39.1 49.3 429 725 A L H <5S- 0 0 8 -4,-2.2 -1,-0.2 -5,-0.1 -2,-0.2 0.404 105.7-127.4 -92.3 1.7 18.5 40.7 52.6 430 726 A N T <5S+ 0 0 108 -4,-0.9 2,-0.2 -3,-0.4 -3,-0.2 0.934 70.3 118.1 49.9 51.2 21.2 38.8 54.4 431 727 A I < - 0 0 43 -5,-2.1 -1,-0.2 -6,-0.1 2,-0.2 -0.750 69.6 -73.5-133.5-179.6 18.8 37.6 57.0 432 728 A S > - 0 0 51 -2,-0.2 4,-2.6 1,-0.1 3,-0.4 -0.521 33.5-122.3 -83.7 148.8 17.3 34.3 58.3 433 729 A R H > S+ 0 0 126 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.884 115.3 54.7 -51.8 -41.9 14.7 32.3 56.4 434 730 A K H > S+ 0 0 136 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.892 110.0 44.8 -60.6 -42.7 12.5 32.6 59.4 435 731 A E H > S+ 0 0 90 -3,-0.4 4,-1.5 2,-0.2 -1,-0.2 0.853 111.3 53.2 -71.1 -35.9 12.7 36.4 59.4 436 732 A A H X S+ 0 0 0 -4,-2.6 4,-1.9 2,-0.2 3,-0.5 0.940 110.1 46.9 -63.7 -47.3 12.2 36.6 55.6 437 733 A A H X S+ 0 0 28 -4,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.841 107.3 60.7 -62.0 -31.9 9.0 34.5 55.9 438 734 A E H X S+ 0 0 115 -4,-1.3 4,-1.4 -5,-0.2 -1,-0.2 0.859 104.3 47.1 -64.0 -37.7 8.1 36.8 58.7 439 735 A F H X S+ 0 0 40 -4,-1.5 4,-2.4 -3,-0.5 -1,-0.2 0.905 109.1 54.6 -70.4 -42.1 8.2 39.8 56.4 440 736 A I H X S+ 0 0 46 -4,-1.9 4,-2.5 1,-0.2 5,-0.2 0.940 107.0 50.9 -54.4 -50.8 6.1 38.0 53.8 441 737 A E H X S+ 0 0 137 -4,-2.4 4,-1.2 1,-0.3 -1,-0.2 0.875 110.2 49.9 -55.5 -40.4 3.4 37.3 56.4 442 738 A R H X S+ 0 0 46 -4,-1.4 4,-1.4 2,-0.2 -1,-0.3 0.874 107.9 53.9 -68.5 -36.4 3.4 41.0 57.3 443 739 A Y H >X S+ 0 0 1 -4,-2.4 4,-2.3 1,-0.2 3,-0.5 0.945 107.3 50.0 -62.8 -47.3 3.1 41.9 53.7 444 740 A F H 3< S+ 0 0 46 -4,-2.5 7,-0.3 1,-0.3 -1,-0.2 0.774 105.5 57.4 -63.2 -26.3 -0.0 39.7 53.2 445 741 A E H 3< S+ 0 0 127 -4,-1.2 -1,-0.3 -5,-0.2 -2,-0.2 0.858 113.1 40.4 -71.7 -33.6 -1.5 41.3 56.3 446 742 A S H << S+ 0 0 18 -4,-1.4 -2,-0.2 -3,-0.5 -1,-0.2 0.766 125.1 37.0 -83.6 -28.3 -1.2 44.6 54.6 447 743 A F >X + 0 0 0 -4,-2.3 4,-1.7 -5,-0.1 3,-0.8 -0.583 66.1 164.1-125.4 68.9 -2.3 43.3 51.2 448 744 A P H 3> S+ 0 0 80 0, 0.0 4,-2.3 0, 0.0 -1,-0.1 0.753 75.3 59.8 -55.9 -29.6 -5.0 40.7 51.9 449 745 A G H 3> S+ 0 0 3 2,-0.2 4,-2.2 1,-0.2 5,-0.1 0.891 104.9 48.5 -67.6 -39.9 -6.1 40.8 48.3 450 746 A V H <> S+ 0 0 1 -3,-0.8 4,-2.6 2,-0.2 -1,-0.2 0.891 110.7 51.3 -66.3 -39.7 -2.7 39.7 47.1 451 747 A K H X S+ 0 0 97 -4,-1.7 4,-2.1 -7,-0.3 -2,-0.2 0.931 110.4 48.9 -62.9 -43.5 -2.7 36.9 49.7 452 748 A R H X S+ 0 0 119 -4,-2.3 4,-2.8 1,-0.2 -2,-0.2 0.897 111.7 49.4 -62.3 -41.8 -6.1 35.7 48.5 453 749 A Y H X S+ 0 0 22 -4,-2.2 4,-3.1 2,-0.2 5,-0.3 0.916 109.2 51.6 -63.9 -44.2 -4.9 35.8 44.9 454 750 A M H X S+ 0 0 23 -4,-2.6 4,-1.4 2,-0.2 -2,-0.2 0.894 113.8 44.1 -60.9 -41.1 -1.8 33.8 45.7 455 751 A E H X S+ 0 0 107 -4,-2.1 4,-1.7 -5,-0.2 -2,-0.2 0.940 116.8 46.4 -69.2 -45.4 -3.9 31.1 47.5 456 752 A N H X S+ 0 0 91 -4,-2.8 4,-2.3 1,-0.2 -2,-0.2 0.857 110.0 51.8 -65.4 -39.2 -6.5 31.1 44.7 457 753 A I H X S+ 0 0 10 -4,-3.1 4,-2.6 2,-0.2 -1,-0.2 0.873 108.5 51.2 -68.5 -36.1 -4.1 30.9 41.8 458 754 A V H X S+ 0 0 16 -4,-1.4 4,-1.7 -5,-0.3 -1,-0.2 0.913 112.1 47.4 -66.2 -40.8 -2.2 27.9 43.4 459 755 A Q H X S+ 0 0 115 -4,-1.7 4,-2.2 1,-0.2 -2,-0.2 0.885 112.1 50.2 -66.7 -37.7 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